N-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide

C13H21N3O3 — CID 138379271

IUPACN-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
SMILESO=C(CN1CCOC1=O)N[C@H]1CCCN2CCC[C@@H]12
InChIInChI=1S/C13H21N3O3/c17-12(9-16-7-8-19-13(16)18)14-10-3-1-5-15-6-2-4-11(10)15/h10-11H,1-9H2,(H,14,17)/t10-,11-/m0/s1
InChIKeyFHYUVKDPKIVSLR-QWRGUYRKSA-N
MW267.33 g/mol
LogP0.18
Rot. Bonds3

About N-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide

N-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide (PubChem CID 138379271) has the molecular formula C13H21N3O3 and a molecular weight of 267.33 g/mol. Its IUPAC name is N-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
PubChem CID138379271
Molecular FormulaC13H21N3O3
Molecular Weight267.33 g/mol
Exact Mass267.16
IUPAC NameN-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
SMILESO=C(CN1CCOC1=O)N[C@H]1CCCN2CCC[C@@H]12
InChIInChI=1S/C13H21N3O3/c17-12(9-16-7-8-19-13(16)18)14-10-3-1-5-15-6-2-4-11(10)15/h10-11H,1-9H2,(H,14,17)/t10-,11-/m0/s1
InChIKeyFHYUVKDPKIVSLR-QWRGUYRKSA-N
XLogP0.18
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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N-[1-[[4-(2-methylpropyl)phenyl]methyl]piperidin-3-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
CID 45215918
2-(2-oxo-1,3-oxazolidin-3-yl)-N-[(3R)-1-(3-phenylpropyl)piperidin-3-yl]acetamide
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4-[(3S,4R)-4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]oxan-3-yl]oxybenzamide
CID 91787674
N-[(1R,5R)-6,6-dimethyl-2-methylidene-3-bicyclo[3.1.1]heptanyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
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2-(cyclopropylmethylamino)-N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)acetamide
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2-(3-amino-1,2,4-triazol-1-yl)-N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)acetamide
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N-[1-[(3,4-difluorophenyl)methyl]piperidin-4-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
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N-[(3S,4S)-1,1-dioxo-4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]thiolan-3-yl]-5-fluoropyridine-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
The IUPAC name of N-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide (CID 138379271) is N-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide.
What is the SMILES notation for N-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
The canonical SMILES for N-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide is O=C(CN1CCOC1=O)N[C@H]1CCCN2CCC[C@@H]12.
What is the InChIKey of N-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
The InChIKey is FHYUVKDPKIVSLR-QWRGUYRKSA-N. The full InChI is InChI=1S/C13H21N3O3/c17-12(9-16-7-8-19-13(16)18)14-10-3-1-5-15-6-2-4-11(10)15/h10-11H,1-9H2,(H,14,17)/t10-,11-/m0/s1.
What are the key properties of N-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
N-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide has a molecular weight of 267.33 g/mol, XLogP of 0.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide is sourced from PubChem (CID 138379271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).